2-[furan-2-yl-[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid

Systemtic Name: 2-[furan-2-yl-[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)-(2-furyl)amino]propanoic acid CAS Name: 2-[2-furanyl-[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)-(furan-2-yl)amino]propanoic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)-(2-furyl)amino]propionic acid Formula: C17H19NO4S MolecularWeight: 333.40206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=CO1)C(=O)C(CC2=CC=CC=C2)CS

Isomeric SMILES

CC(C(=O)O)N(C1=CC=CO1)C(=O)C(CC2=CC=CC=C2)CS

InChI

InChI=1S/C17H19NO4S/c1-12(17(20)21)18(15-8-5-9-22-15)16(19)14(11-23)10-13-6-3-2-4-7-13/h2-9,12,14,23H,10-11H2,1H3,(H,20,21)